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4-(7'-chloroquinolin-4'-ylamino)-2,6-bis(diethylaminomethyl)-3-methylphenol
SpectraBase Compound ID L91BNt1pJB1
InChI InChI=1S/C26H35ClN4O/c1-6-30(7-2)16-19-14-24(18(5)22(26(19)32)17-31(8-3)9-4)29-23-12-13-28-25-15-20(27)10-11-21(23)25/h10-15,32H,6-9,16-17H2,1-5H3,(H,28,29)
InChIKey ZJPKIIULLSMLJX-UHFFFAOYSA-N
Mol Weight 455.0 g/mol
Molecular Formula C26H35ClN4O
Exact Mass 454.249939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6u2IXix0HZE
Name 4-(7'-chloroquinolin-4'-ylamino)-2,6-bis(diethylaminomethyl)-3-methylphenol
Alternate Name(s) 4-[(7-chloro-4-quinolinyl)amino]-2,6-bis[(diethylamino)methyl]-3-methylphenol
Comments Less than 3 mono-isotopic peaks
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Formula C26H35ClN4O
InChI InChI=1S/C26H35ClN4O/c1-6-30(7-2)16-19-14-24(18(5)22(26(19)32)17-31(8-3)9-4)29-23-12-13-28-25-15-20(27)10-11-21(23)25/h10-15,32H,6-9,16-17H2,1-5H3,(H,28,29)
InChIKey ZJPKIIULLSMLJX-UHFFFAOYSA-N
Molecular Weight 455.046 g/mol
SMILES N(c1cc(c(c(c1C)CN(CC)CC)O)CN(CC)CC)c1c2c(cc(cc2)Cl)ncc1
SPLASH splash10-004i-0000900000-20d79a04335a9316a541
Source of Spectrum B-44-151-0
Wiley ID 1388799